CID9896057
ethyl (2R)-4-(6-chloronaphthalen-2-yl)sulfonyl-6-oxo-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazine-2-carboxylate;methanesulfonic acid
Also Known As: m55190|M 55165
CAS: 229646-72-4
| Molecular Formula | C29H35ClN4O8S2 |
|---|---|
| Molecular Weight | 666.1585 g/mol |
| LogP | 3.0734 |
| Topological Polar Surface Area | 154.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 666.1585 |
| Monoisotopic Mass | 666.1585 |
| Heavy Atoms | 44 |
| Complexity | 1690.7843 |
Chemical Identifiers
| CAS Number | 229646-72-4 |
|---|---|
| SMILES | CCOC(=O)[C@H]1CN(CC(=O)N1CC2CCN(CC2)C3=CC=NC=C3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl.CS(=O)(=O)O |
Product Overview
CID9896057 (CAS 229646-72-4), with molecular formula C29H35ClN4O8S2 and molecular weight 666.1585 g/mol. IUPAC: ethyl (2R)-4-(6-chloronaphthalen-2-yl)sulfonyl-6-oxo-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazine-2-carboxylate;methanesulfonic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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